ChemSpider 2D Image | (3-Deoxy-3-(2,3,5,6-Tetra-Fluoro-4-Methoxy-Benzamido)-B-D-Galactopyranosyl)-(3-Deoxy-3-(2,3,5,6-Tetra-Fluoro-4-Methoxy-Benzamido)-2-O-Sulfo-B-D-Galactopyranosyl)-Sulfide | C28H28F8N2O15S2

(3-Deoxy-3-(2,3,5,6-Tetra-Fluoro-4-Methoxy-Benzamido)-B-D-Galactopyranosyl)-(3-Deoxy-3-(2,3,5,6-Tetra-Fluoro-4-Methoxy-Benzamido)-2-O-Sulfo-B-D-Galactopyranosyl)-Sulfide

  • Molecular FormulaC28H28F8N2O15S2
  • Average mass848.643 Da
  • Monoisotopic mass848.080322 Da
  • ChemSpider ID35035681

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(3-Deoxy-3-(2,3,5,6-Tetra-Fluoro-4-Methoxy-Benzamido)-B-D-Galactopyranosyl)-(3-Deoxy-3-(2,3,5,6-Tetra-Fluoro-4-Methoxy-Benzamido)-2-O-Sulfo-B-D-Galactopyranosyl)-Sulfide
3-Deoxy-3-[(2,3,5,6-tetrafluoro-4-methoxybenzoyl)amino]-β-D-galactopyranosyl 3-deoxy-2-O-sulfo-3-[(2,3,5,6-tetrafluoro-4-methoxybenzoyl)amino]-1-thio-β-D-galactopyranoside [ACD/IUPAC Name]
3-Désoxy-2-O-sulfo-3-[(2,3,5,6-tétrafluoro-4-méthoxybenzoyl)amino]-1-thio-β-D-galactopyranoside de 3-désoxy-3-[(2,3,5,6-tétrafluoro-4-méthoxybenzoyl)amino]-β-D-galactopyranosyle [French] [ACD/IUPAC Name]
3-Desoxy-3-[(2,3,5,6-tetrafluor-4-methoxybenzoyl)amino]-β-D-galactopyranosyl-3-desoxy-2-O-sulfo-3-[(2,3,5,6-tetrafluor-4-methoxybenzoyl)amino]-1-thio-β-D-galactopyranosid [German] [ACD/IUPAC Name]
β-D-Galactopyranoside, 3-deoxy-3-[(2,3,5,6-tetrafluoro-4-methoxybenzoyl)amino]-β-D-galactopyranosyl 3-deoxy-3-[(2,3,5,6-tetrafluoro-4-methoxybenzoyl)amino]-1-thio-, 2-(hydrogen sulfate) [ACD/Index Name]
A6J

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.622
Molar Refractivity: 164.4±0.4 cm3
#H bond acceptors: 17
#H bond donors: 8
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: 1.26
ACD/LogD (pH 5.5): -3.91
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.92
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 294 Å2
Polarizability: 65.2±0.5 10-24cm3
Surface Tension: 80.1±5.0 dyne/cm
Molar Volume: 467.0±5.0 cm3

Click to predict properties on the Chemicalize site


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